5-[(BENZOTHIAZOL-2-YL)-CYANOMETHYLENE]-3-METHYL-4,5-DIHYDRO-1,2,3-THIADIAZOL-3-IUM-4-IDE

SpectraBase Compound ID	DWZn76GHU5f
InChI	InChI=1S/C12H8N4S2/c1-16-7-11(18-15-16)8(6-13)12-14-9-4-2-3-5-10(9)17-12/h2-5,7H,1H3/b11-8-
InChIKey	NUTSYXLGVORUOJ-FLIBITNWSA-N Google Search
Mol Weight	272.34 g/mol
Molecular Formula	C12H8N4S2
Exact Mass	272.019039 g/mol

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SpectraBase Spectrum ID	7VvOJKaUxFQ
Name	5-[(BENZOTHIAZOL-2-YL)-CYANOMETHYLENE]-3-METHYL-4,5-DIHYDRO-1,2,3-THIADIAZOL-3-IUM-4-IDE
Compound Number	14
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C12H8N4S2/c1-16-7-11(18-15-16)8(6-13)12-14-9-4-2-3-5-10(9)17-12/h2-5,7H,1H3/b11-8-
InChIKey	NUTSYXLGVORUOJ-FLIBITNWSA-N
Literature Reference	G.LABBE,L.BASTIN,W.DEHAEN,S.TOPPET,P.DELBEKE,D.VLIEGHE,L.VANMEERVELT J.CHEM.SOC.PERKIN-1,2545(1994)
Solvent	Dimethyl sulfoxide-d6